2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate,dihydrochloride
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![2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate,dihydrochloride structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/d4d4a41d661e48248ef06a95a5f9bc0e.png "2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate,dihydrochloride")
2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate,dihydrochloride
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CAS No:
55300-35-1
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Formula:
C29H28Cl3F3N4O2S
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Chemical Name:
2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate,dihydrochloride
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Synonyms:
Piperazineethanol,4-(3-(trifluoromethylthio)phenyl)-,N-(7-chloro-4-quinolyl)anthranilate,dihydrochloride; 4-(3-Trifluoromethylthio)phenylpiperazineethanol o-(7-chloro-4-quinolylamino)benzoate 2HCl; 2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate dihydrochloride;
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CAS No:
2-[4-[3-(trifluoromethylsulfanyl)phenyl]piperazin-1-yl]ethyl 2-[(7-chloroquinolin-4-yl)amino]benzoate,dihydrochloride Basic Attributes
659.97700
658.095065
DTXSID40203836
Computed Properties
Molecular Weight:660.0
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:9
Exact Mass:658.095065
Monoisotopic Mass:658.095065
Topological Polar Surface Area:83
Heavy Atom Count:42
Complexity:819
Covalently-Bonded Unit Count:3
Compound Is Canonicalized:Yes
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